[4-(3-carboxy-1-ethyl-6-fluoranyl-4-oxidanylidene-1H-quinolin-1-ium-7-yl)-1,3-thiazol-2-yl]-dimethyl-azanium

Systemtic Name: [4-(3-carboxy-1-ethyl-6-fluoranyl-4-oxidanylidene-1H-quinolin-1-ium-7-yl)-1,3-thiazol-2-yl]-dimethyl-azanium Openeye Name: [4-(3-carboxy-1-ethyl-6-fluoro-4-oxo-1H-quinolin-1-ium-7-yl)thiazol-2-yl]-dimethyl-ammonium CAS Name: [4-(3-carboxy-1-ethyl-6-fluoro-4-oxo-1H-quinolin-1-ium-7-yl)-2-thiazolyl]-dimethylammonium IUPAC Name: [4-(3-carboxy-1-ethyl-6-fluoro-4-oxo-1H-quinolin-1-ium-7-yl)-1,3-thiazol-2-yl]-dimethylazanium Traditional Name: [4-(3-carboxy-1-ethyl-6-fluoro-4-keto-1H-quinolin-1-ium-7-yl)thiazol-2-yl]-dimethyl-ammonium Formula: C17H18FN3O3S+2 MolecularWeight: 363.406523

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1C=C(C(=O)C2=C1C=C(C(=C2)F)C3=CSC(=N3)[NH+](C)C)C(=O)O

Isomeric SMILES

CC[NH+]1C=C(C(=O)C2=C1C=C(C(=C2)F)C3=CSC(=N3)[NH+](C)C)C(=O)O

InChI

InChI=1S/C17H16FN3O3S/c1-4-21-7-11(16(23)24)15(22)10-5-12(18)9(6-14(10)21)13-8-25-17(19-13)20(2)3/h5-8H,4H2,1-3H3,(H,23,24)/p+2